Geometry & MOs

Info

ID:	58672
PubChem CID:	24712452
Reduced:	N3O4H15C18 (1)
Stoich.:	A3B4C15D18 (1)
Weight, g/mol:	342.083827
ΔH_f, kcal/mol:	-82.16
Dipole, Da:	6.53
IP(EA), eV:	-9.74(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[(3-fluorophenoxy)methyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=O)N(C(=O)C(=N2)C(=O)O)CC3=CC=CC=C3

DOS

IR

Vibrations